1-(2-hydroxyethyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide

C13H22N4O2 — CID 118772758

IUPAC1-(2-hydroxyethyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide
SMILESO=C(NCCc1ncc[nH]1)C1CCCN(CCO)C1
InChIInChI=1S/C13H22N4O2/c18-9-8-17-7-1-2-11(10-17)13(19)16-4-3-12-14-5-6-15-12/h5-6,11,18H,1-4,7-10H2,(H,14,15)(H,16,19)
InChIKeyFWEMSDYEOLYHRI-UHFFFAOYSA-N
MW266.34 g/mol
LogP-0.23
Rot. Bonds6

About 1-(2-hydroxyethyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide

1-(2-hydroxyethyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide (PubChem CID 118772758) has the molecular formula C13H22N4O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is 1-(2-hydroxyethyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name1-(2-hydroxyethyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide
PubChem CID118772758
Molecular FormulaC13H22N4O2
Molecular Weight266.34 g/mol
Exact Mass266.17
IUPAC Name1-(2-hydroxyethyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide
SMILESO=C(NCCc1ncc[nH]1)C1CCCN(CCO)C1
InChIInChI=1S/C13H22N4O2/c18-9-8-17-7-1-2-11(10-17)13(19)16-4-3-12-14-5-6-15-12/h5-6,11,18H,1-4,7-10H2,(H,14,15)(H,16,19)
InChIKeyFWEMSDYEOLYHRI-UHFFFAOYSA-N
XLogP-0.23
TPSA81.25 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 5-0.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

1-ethyl-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide
CID 119073659
1-(cyclopropanecarbonyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide
CID 115620012
N-(2-aminoethyl)-1-(2-hydroxyethyl)piperidine-3-carboxamide
CID 63253182
(3S)-1-(2-hydroxyethyl)-N-[2-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]ethyl]piperidine-3-carboxamide
CID 124756513
N-[2-(1H-imidazol-2-yl)ethyl]oxane-2-carboxamide
CID 115747744
N-[2-(1H-imidazol-2-yl)ethyl]-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide
CID 115668365
(3R)-1-N-cyclopentyl-3-N-(1H-imidazol-2-ylmethyl)piperidine-1,3-dicarboxamide
CID 96568857
2-(3-hydroxypiperidin-1-yl)-N-[3-(1H-imidazol-2-yl)propyl]acetamide
CID 91777804
4-butyl-N-[2-(1H-imidazol-2-yl)ethyl]cyclohexane-1-carboxamide
CID 115649554
N-[2-(1H-imidazol-2-yl)ethyl]-3-methyloxolane-2-carboxamide
CID 115735316
N-(2-aminoethyl)-1-[[1-(2-hydroxyethyl)pyrazol-4-yl]methyl]piperidine-3-carboxamide
CID 64829338
1-cyclopropyl-3-[2-(1H-imidazol-2-yl)ethyl]thiourea
CID 116510338

Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxyethyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide?
The IUPAC name of 1-(2-hydroxyethyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide (CID 118772758) is 1-(2-hydroxyethyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide.
What is the SMILES notation for 1-(2-hydroxyethyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide?
The canonical SMILES for 1-(2-hydroxyethyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide is O=C(NCCc1ncc[nH]1)C1CCCN(CCO)C1.
What is the InChIKey of 1-(2-hydroxyethyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide?
The InChIKey is FWEMSDYEOLYHRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2/c18-9-8-17-7-1-2-11(10-17)13(19)16-4-3-12-14-5-6-15-12/h5-6,11,18H,1-4,7-10H2,(H,14,15)(H,16,19).
What are the key properties of 1-(2-hydroxyethyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide?
1-(2-hydroxyethyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide has a molecular weight of 266.34 g/mol, XLogP of -0.23, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxyethyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide is sourced from PubChem (CID 118772758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).